Geometry & MOs

Info

ID:	205196
PubChem CID:	80066876
Reduced:	OSN2C13H16 (1)
Stoich.:	ABC2D13E16 (1)
Weight, g/mol:	246.148061
ΔH_f, kcal/mol:	5.95
Dipole, Da:	2.51
IP(EA), eV:	-8.91(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-ethylpyrazol-3-yl)-2-(6-methoxypyridin-3-yl)ethanamine

Drug info:

PubChemData

Smile

CC1=CC(=CS1)C(CC2=CN=C(C=C2)OC)N

DOS

IR

Vibrations